6-phenylmethoxy-4-[(5-propan-2-yl-1H-pyrazol-3-yl)carbonyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 6-phenylmethoxy-4-[(5-propan-2-yl-1H-pyrazol-3-yl)carbonyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-(5-isopropyl-1H-pyrazole-3-carbonyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[oxo-(5-propan-2-yl-1H-pyrazol-3-yl)methyl]-6-phenylmethoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 6-phenylmethoxy-4-(5-propan-2-yl-1H-pyrazole-3-carbonyl)-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-(5-isopropyl-1H-pyrazole-3-carbonyl)-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC(=NN1)C(=O)N2CC(CN(C(=O)C2)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-18(2)22-11-23(28-27-22)25(32)30-15-21(33-17-19-7-4-3-5-8-19)14-29(24(31)16-30)13-20-9-6-10-26-12-20/h3-12,18,21H,13-17H2,1-2H3,(H,27,28)